CID 55912

Brn 2757335

Structural Information

Molecular Formula

C₁₆H₂₅N₃O₃

SMILES

CCOC1=CC=C(C=C1)N(CC(=O)N(C)C)C(=O)CN(C)C

InChI

InChI=1S/C16H25N3O3/c1-6-22-14-9-7-13(8-10-14)19(12-15(20)18(4)5)16(21)11-17(2)3/h7-10H,6,11-12H2,1-5H3

InChIKey

RWUYUAAYCVYXBA-UHFFFAOYSA-N

Compound name

2-(dimethylamino)-N-[2-(dimethylamino)-2-oxoethyl]-N-(4-ethoxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 307.1896 Da
Monoisotopic Mass: 1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	308.196876	176.2
[M+Na]+	330.178818	179.4
[M-H]-	306.182324	183.2
[M+NH4]+	325.223423	191.8
[M+K]+	346.152758	181.5
[M+H-H2O]+	290.186860	167.4
[M+HCOO]-	352.187801	202.0
[M+CH3COO]-	366.203451	223.6
[M+Na-2H]-	328.164266	176.2
[M]+	307.18905142	182.0
[M]-	307.19014858	182.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe